It is easy enough if you still ant to do it. I would feed both into f2mtz separately to make a mysadIplus.mtz and a mysadImin.mtz then use CAD to combine and change the default labels to something like I(+) SIGI(+) and I(-) SIGI(-)
But as George says Why do you want it? That will change the way you proceed. Eleanor On 14 Nov 2013, at 21:08, George Sheldrick wrote: > I'm not sure why you want to do that. If you wish to look at a map or > poly-Ala trace from SHELXE, just read the .pdb and then .phs files into Coot > directly. If you want to use them to make pictures with PYMOL, use Tim > Gruene's SHELX2map. For further information please go to the SHELX homepage > (Google knows where it is). > > George > > On 11/14/2013 10:09 PM, Yarrow Madrona wrote: >> I'm sorry, >> >> I have not used shelx before and didn't realize in my last post that the >> anamolous data is kept separate. I am planning on converting both the >> mysad.phs and mysad.pha to mtz files and then merge them. However, I am >> not sure of the column lables in mysad.pha. Does anyone know how to get >> this info? >> >> -Yarrow >> > > > -- > Prof. George M. Sheldrick FRS > Dept. Structural Chemistry, > University of Goettingen, > Tammannstr. 4, > D37077 Goettingen, Germany > Tel. +49-551-39-33021 or -33068 > Fax. +49-551-39-22582
